4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide

C15H30N4O — CID 172435138

IUPAC4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide
SMILESCC(C)CNC(=O)N1CCN(CC1)C2CCN(CC2)C
InChIInChI=1S/C15H30N4O/c1-13(2)12-16-15(20)19-10-8-18(9-11-19)14-4-6-17(3)7-5-14/h13-14H,4-12H2,1-3H3,(H,16,20)
InChIKeyVXYOEOXPDKAYEZ-UHFFFAOYSA-N
MW282.43 g/mol
LogP1.30
Rot. Bonds3

About 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide

4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide (PubChem CID 172435138) has the molecular formula C15H30N4O and a molecular weight of 282.43 g/mol. Its IUPAC name is 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide
PubChem CID172435138
Molecular FormulaC15H30N4O
Molecular Weight282.43 g/mol
Exact Mass282.24
IUPAC Name4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide
SMILESCC(C)CNC(=O)N1CCN(CC1)C2CCN(CC2)C
InChIInChI=1S/C15H30N4O/c1-13(2)12-16-15(20)19-10-8-18(9-11-19)14-4-6-17(3)7-5-14/h13-14H,4-12H2,1-3H3,(H,16,20)
InChIKeyVXYOEOXPDKAYEZ-UHFFFAOYSA-N
XLogP1.30
TPSA38.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity305

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclohexyl-4-methylpiperazine-1-carboxamide
CID 306772
1-(1-Piperidinylcarbonyl)piperazine
CID 1095015
1-Piperidinecarboxamide, 3-amino-N,N-dimethyl-
CID 21482877
3-Methyl-1-(1-methylpiperidin-4-yl)urea
CID 59833286
(8aS)-7-(1-methylpiperidin-4-yl)-1,2,5,6,8,8a-hexahydroimidazo[1,5-a]pyrazin-3-one
CID 75368548
N-cyclohexyl-4-ethylpiperazine-1-carboxamide
CID 858169
1-(1-Ethylpiperidin-4-yl)-3-propylurea
CID 6468806
1,1-Dimethyl-3-(piperidin-4-yl)urea
CID 18677692
4-amino-N-tert-butylpiperidine-1-carboxamide
CID 28785595
1,3-Di(piperidin-4-yl)urea
CID 58973009
3,3-Dimethyl-1-(piperidin-3-yl)urea
CID 67338659
3-oxo-4-piperidin-4-yl-N-propan-2-ylpiperazine-1-carboxamide
CID 134789055

Frequently Asked Questions

What is the IUPAC name of 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide?
The IUPAC name of 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide (CID 172435138) is 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide?
The canonical SMILES for 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide is CC(C)CNC(=O)N1CCN(CC1)C2CCN(CC2)C.
What is the InChIKey of 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide?
The InChIKey is VXYOEOXPDKAYEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4O/c1-13(2)12-16-15(20)19-10-8-18(9-11-19)14-4-6-17(3)7-5-14/h13-14H,4-12H2,1-3H3,(H,16,20).
What are the key properties of 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide?
4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide has a molecular weight of 282.43 g/mol, XLogP of 1.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methylpiperidin-4-yl)-N-(2-methylpropyl)piperazine-1-carboxamide is sourced from PubChem (CID 172435138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).